W9N
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C39 | C38 | sing | 1.56Å | 1.54Å | |
| C39 | C12 | sing | 1.55Å | 1.55Å | |
| C38 | C10 | sing | 1.55Å | 1.54Å | |
| C35 | C34 | sing | 1.51Å | 1.40Å | |
| C35 | C37 | sing | 1.53Å | 1.40Å | |
| C34 | O36 | doub | 1.21Å | 1.24Å | |
| C34 | N11 | sing | 1.35Å | 1.34Å | |
| C12 | N11 | sing | 1.48Å | 1.46Å | |
| C12 | C13 | sing | 1.54Å | 1.55Å | |
| N11 | C10 | sing | 1.48Å | 1.48Å | |
| C10 | C15 | sing | 1.54Å | 1.55Å | |
| C13 | C14 | sing | 1.53Å | 1.56Å | |
| C15 | C14 | sing | 1.53Å | 1.52Å | |
| C14 | N5 | sing | 1.46Å | 1.45Å | |
| N6 | N5 | sing | 1.40Å | 1.38Å | Aromatic |
| N6 | C7 | doub | 1.31Å | 1.33Å | Aromatic |
| N5 | C4 | sing | 1.36Å | 1.37Å | Aromatic |
| C18 | C19 | doub | 1.38Å | 1.42Å | Aromatic |
| C18 | C17 | sing | 1.39Å | 1.41Å | Aromatic |
| C19 | C20 | sing | 1.39Å | 1.41Å | Aromatic |
| C7 | C17 | sing | 1.48Å | 1.45Å | |
| C7 | C8 | sing | 1.46Å | 1.43Å | Aromatic |
| C4 | N3 | doub | 1.33Å | 1.35Å | Aromatic |
| C4 | C8 | sing | 1.41Å | 1.39Å | Aromatic |
| C17 | C22 | doub | 1.39Å | 1.44Å | Aromatic |
| C20 | O23 | sing | 1.36Å | 1.36Å | |
| C20 | C21 | doub | 1.39Å | 1.41Å | Aromatic |
| O23 | C24 | sing | 1.36Å | 1.38Å | |
| N3 | C2 | sing | 1.32Å | 1.34Å | Aromatic |
| C8 | C9 | doub | 1.39Å | 1.41Å | Aromatic |
| C25 | C24 | doub | 1.39Å | 1.42Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.42Å | Aromatic |
| C24 | C29 | sing | 1.38Å | 1.43Å | Aromatic |
| C22 | C21 | sing | 1.38Å | 1.41Å | Aromatic |
| C21 | C40 | sing | 1.51Å | 1.53Å | |
| C26 | C27 | doub | 1.39Å | 1.41Å | Aromatic |
| C2 | N1 | doub | 1.32Å | 1.36Å | Aromatic |
| C29 | C28 | doub | 1.40Å | 1.42Å | Aromatic |
| C9 | N1 | sing | 1.32Å | 1.35Å | Aromatic |
| C9 | C16 | sing | 1.51Å | 1.51Å | |
| C27 | C28 | sing | 1.41Å | 1.39Å | Aromatic |
| C27 | N30 | sing | 1.38Å | 1.39Å | Aromatic |
| C28 | N32 | sing | 1.36Å | 1.38Å | Aromatic |
| N30 | C33 | sing | 1.46Å | 1.47Å | |
| N30 | C31 | sing | 1.36Å | 1.36Å | Aromatic |
| N32 | C31 | doub | 1.30Å | 1.33Å | Aromatic |
| C18 | H1 | sing | 1.08Å | 1.08Å | |
| C14 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.09Å | 1.10Å | |
| C12 | H5 | sing | 1.09Å | 1.10Å | |
| C16 | H6 | sing | 1.09Å | 1.10Å | |
| C16 | H7 | sing | 1.09Å | 1.10Å | |
| C16 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| C22 | H12 | sing | 1.08Å | 1.08Å | |
| C19 | H13 | sing | 1.08Å | 1.08Å | |
| C2 | H14 | sing | 1.08Å | 1.08Å | |
| C25 | H15 | sing | 1.08Å | 1.08Å | |
| C26 | H16 | sing | 1.08Å | 1.08Å | |
| C29 | H17 | sing | 1.08Å | 1.08Å | |
| C31 | H18 | sing | 1.08Å | 1.08Å | |
| C33 | H19 | sing | 1.09Å | 1.10Å | |
| C33 | H20 | sing | 1.09Å | 1.10Å | |
| C33 | H21 | sing | 1.09Å | 1.10Å | |
| C35 | H22 | sing | 1.09Å | 1.10Å | |
| C35 | H23 | sing | 1.09Å | 1.10Å | |
| C37 | H24 | sing | 1.09Å | 1.10Å | |
| C37 | H25 | sing | 1.09Å | 1.10Å | |
| C37 | H26 | sing | 1.09Å | 1.10Å | |
| C38 | H27 | sing | 1.09Å | 1.10Å | |
| C38 | H28 | sing | 1.09Å | 1.10Å | |
| C39 | H29 | sing | 1.09Å | 1.10Å | |
| C39 | H30 | sing | 1.09Å | 1.10Å | |
| C40 | H31 | sing | 1.09Å | 1.10Å | |
| C40 | H32 | sing | 1.09Å | 1.10Å | |
| C40 | H33 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C38 | C39 | C12 | 105.1° | 104.9° |
| C39 | C38 | C10 | 105.0° | 104.0° |
| C39 | C38 | H27 | 110.6° | 111.0° |
| C39 | C38 | H28 | 110.6° | 110.6° |
| C38 | C39 | H29 | 110.6° | 110.4° |
| C38 | C39 | H30 | 110.5° | 110.4° |
| C39 | C12 | N11 | 103.5° | 104.2° |
| C39 | C12 | C13 | 112.5° | 107.9° |
| C39 | C12 | H5 | 111.9° | 112.7° |
| C12 | C39 | H29 | 110.5° | 110.3° |
| C12 | C39 | H30 | 110.6° | 110.3° |
| C38 | C10 | N11 | 103.1° | 104.8° |
| C38 | C10 | C15 | 106.5° | 107.8° |
| C38 | C10 | H11 | 112.5° | 112.2° |
| C10 | C38 | H27 | 110.6° | 110.4° |
| C10 | C38 | H28 | 110.6° | 110.4° |
| C34 | C35 | C37 | 112.1° | 109.5° |
| C35 | C34 | O36 | 120.2° | 120.0° |
| C35 | C34 | N11 | 116.5° | 120.0° |
| C34 | C35 | H22 | 108.8° | 109.5° |
| C34 | C35 | H23 | 108.8° | 109.5° |
| C37 | C35 | H22 | 108.8° | 109.4° |
| C37 | C35 | H23 | 108.8° | 109.5° |
| C35 | C37 | H24 | 109.5° | 109.4° |
| C35 | C37 | H25 | 109.5° | 109.5° |
| C35 | C37 | H26 | 109.4° | 109.6° |
| O36 | C34 | N11 | 123.3° | 120.0° |
| C34 | N11 | C12 | 126.2° | 128.2° |
| C34 | N11 | C10 | 127.8° | 128.2° |
| N11 | C12 | C13 | 103.1° | 107.2° |
| C12 | N11 | C10 | 105.8° | 103.6° |
| N11 | C12 | H5 | 113.3° | 112.2° |
| C12 | C13 | C14 | 113.0° | 108.9° |
| C12 | C13 | H3 | 108.6° | 109.6° |
| C12 | C13 | H4 | 108.6° | 109.7° |
| C13 | C12 | H5 | 112.0° | 112.1° |
| N11 | C10 | C15 | 108.3° | 107.3° |
| N11 | C10 | H11 | 113.4° | 112.2° |
| C10 | C15 | C14 | 109.7° | 108.9° |
| C10 | C15 | H9 | 109.4° | 109.6° |
| C10 | C15 | H10 | 109.4° | 109.6° |
| C15 | C10 | H11 | 112.4° | 112.1° |
| C13 | C14 | C15 | 110.0° | 109.6° |
| C13 | C14 | N5 | 107.1° | 109.4° |
| C13 | C14 | H2 | 107.8° | 109.4° |
| C14 | C13 | H3 | 108.6° | 109.6° |
| C14 | C13 | H4 | 108.6° | 109.5° |
| C15 | C14 | N5 | 114.2° | 109.5° |
| C15 | C14 | H2 | 108.4° | 109.4° |
| C14 | C15 | H9 | 109.4° | 109.6° |
| C14 | C15 | H10 | 109.4° | 109.6° |
| C14 | N5 | N6 | 119.7° | 125.2° |
| C14 | N5 | C4 | 127.8° | 125.3° |
| N5 | C14 | H2 | 109.2° | 109.5° |
| N5 | N6 | C7 | 106.1° | 110.0° |
| N6 | N5 | C4 | 112.4° | 109.5° |
| N6 | C7 | C17 | 113.3° | 126.3° |
| N6 | C7 | C8 | 109.4° | 107.4° |
| N5 | C4 | N3 | 132.3° | 134.5° |
| N5 | C4 | C8 | 105.1° | 106.8° |
| C19 | C18 | C17 | 118.3° | 119.9° |
| C18 | C19 | C20 | 120.1° | 120.1° |
| C19 | C18 | H1 | 120.9° | 120.0° |
| C18 | C19 | H13 | 119.9° | 119.9° |
| C18 | C17 | C7 | 118.6° | 120.1° |
| C18 | C17 | C22 | 120.8° | 119.8° |
| C17 | C18 | H1 | 120.9° | 120.0° |
| C19 | C20 | O23 | 117.3° | 120.0° |
| C19 | C20 | C21 | 122.6° | 120.1° |
| C20 | C19 | H13 | 120.0° | 120.0° |
| C17 | C7 | C8 | 137.3° | 126.3° |
| C7 | C17 | C22 | 119.9° | 120.1° |
| C7 | C8 | C4 | 107.0° | 106.3° |
| C7 | C8 | C9 | 135.6° | 135.1° |
| N3 | C4 | C8 | 122.6° | 118.6° |
| C4 | N3 | C2 | 114.7° | 120.4° |
| C4 | C8 | C9 | 117.5° | 118.6° |
| C17 | C22 | C21 | 120.5° | 120.0° |
| C17 | C22 | H12 | 119.7° | 120.0° |
| O23 | C20 | C21 | 120.0° | 119.9° |
| C20 | O23 | C24 | 119.7° | 118.0° |
| C20 | C21 | C22 | 117.5° | 120.0° |
| C20 | C21 | C40 | 120.7° | 120.0° |
| O23 | C24 | C25 | 116.7° | 119.8° |
| O23 | C24 | C29 | 120.2° | 119.8° |
| N3 | C2 | N1 | 128.9° | 122.6° |
| N3 | C2 | H14 | 115.5° | 118.7° |
| C8 | C9 | N1 | 121.8° | 118.5° |
| C8 | C9 | C16 | 125.0° | 120.7° |
| C24 | C25 | C26 | 119.0° | 120.4° |
| C25 | C24 | C29 | 123.1° | 120.4° |
| C24 | C25 | H15 | 120.5° | 119.8° |
| C25 | C26 | C27 | 117.0° | 119.9° |
| C26 | C25 | H15 | 120.5° | 119.8° |
| C25 | C26 | H16 | 121.5° | 120.1° |
| C24 | C29 | C28 | 116.9° | 119.7° |
| C24 | C29 | H17 | 121.6° | 120.2° |
| C22 | C21 | C40 | 121.8° | 120.0° |
| C21 | C22 | H12 | 119.7° | 120.0° |
| C21 | C40 | H31 | 109.5° | 109.4° |
| C21 | C40 | H32 | 109.4° | 109.4° |
| C21 | C40 | H33 | 109.5° | 109.4° |
| C26 | C27 | C28 | 124.3° | 120.1° |
| C26 | C27 | N30 | 127.8° | 134.0° |
| C27 | C26 | H16 | 121.5° | 120.0° |
| C2 | N1 | C9 | 114.5° | 121.3° |
| N1 | C2 | H14 | 115.6° | 118.7° |
| C29 | C28 | C27 | 119.7° | 119.5° |
| C29 | C28 | N32 | 129.1° | 133.6° |
| C28 | C29 | H17 | 121.6° | 120.0° |
| N1 | C9 | C16 | 113.2° | 120.8° |
| C9 | C16 | H6 | 109.5° | 109.5° |
| C9 | C16 | H7 | 109.5° | 109.5° |
| C9 | C16 | H8 | 109.4° | 109.5° |
| C28 | C27 | N30 | 107.9° | 106.0° |
| C27 | C28 | N32 | 111.2° | 106.9° |
| C27 | N30 | C33 | 129.3° | 126.3° |
| C27 | N30 | C31 | 101.4° | 107.3° |
| C28 | N32 | C31 | 100.3° | 109.7° |
| C33 | N30 | C31 | 129.2° | 126.4° |
| N30 | C33 | H19 | 109.5° | 109.5° |
| N30 | C33 | H20 | 109.5° | 109.5° |
| N30 | C33 | H21 | 109.5° | 109.5° |
| N30 | C31 | N32 | 119.1° | 110.1° |
| N30 | C31 | H18 | 120.4° | 124.9° |
| N32 | C31 | H18 | 120.5° | 125.0° |
| H3 | C13 | H4 | 109.4° | 109.6° |
| H6 | C16 | H7 | 109.5° | 109.5° |
| H6 | C16 | H8 | 109.5° | 109.4° |
| H7 | C16 | H8 | 109.4° | 109.4° |
| H9 | C15 | H10 | 109.5° | 109.5° |
| H19 | C33 | H20 | 109.5° | 109.5° |
| H19 | C33 | H21 | 109.4° | 109.5° |
| H20 | C33 | H21 | 109.5° | 109.5° |
| H22 | C35 | H23 | 109.4° | 109.4° |
| H24 | C37 | H25 | 109.4° | 109.4° |
| H24 | C37 | H26 | 109.5° | 109.5° |
| H25 | C37 | H26 | 109.5° | 109.5° |
| H27 | C38 | H28 | 109.5° | 110.3° |
| H29 | C39 | H30 | 109.5° | 110.4° |
| H31 | C40 | H32 | 109.5° | 109.5° |
| H31 | C40 | H33 | 109.5° | 109.5° |
| H32 | C40 | H33 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C38 | C39 | C12 | H29 | 119.3° | 118.9° |
| C38 | C39 | C12 | H30 | 119.3° | 118.9° |
| C39 | C38 | C10 | H27 | 119.3° | 119.1° |
| C39 | C38 | C10 | H28 | 119.3° | 118.7° |
| C38 | C39 | C12 | N11 | 23.3° | 25.1° |
| C38 | C39 | C12 | C13 | 87.3° | 88.6° |
| C39 | C38 | C10 | N11 | 25.1° | 25.2° |
| C39 | C38 | C10 | C15 | 88.8° | 88.9° |
| C38 | C39 | C12 | H5 | 145.6° | 147.0° |
| C39 | C38 | C10 | H11 | 147.7° | 147.2° |
| C39 | C38 | H27 | H28 | 122.1° | 122.9° |
| C38 | C39 | H29 | H30 | 122.0° | 122.4° |
| C12 | C39 | C38 | C10 | 1.4° | 0.0° |
| C39 | C12 | N11 | C34 | 134.6° | 138.4° |
| C39 | C12 | N11 | C13 | 117.4° | 114.2° |
| C39 | C12 | N11 | H5 | 121.4° | 122.3° |
| C39 | C12 | C13 | H5 | 127.0° | 124.7° |
| C39 | C12 | N11 | C10 | 40.6° | 41.6° |
| C39 | C12 | C13 | C14 | 93.1° | 47.7° |
| C39 | C12 | C13 | H3 | 27.5° | 167.6° |
| C39 | C12 | C13 | H4 | 146.4° | 72.1° |
| C12 | C39 | C38 | H27 | 117.9° | 118.7° |
| C12 | C39 | C38 | H28 | 120.7° | 118.6° |
| C12 | C39 | H29 | H30 | 122.0° | 122.1° |
| C38 | C10 | N11 | C34 | 133.5° | 138.2° |
| C38 | C10 | N11 | C12 | 41.5° | 41.8° |
| C38 | C10 | N11 | C15 | 112.6° | 114.4° |
| C38 | C10 | N11 | H11 | 121.9° | 122.0° |
| C38 | C10 | C15 | H11 | 123.6° | 124.0° |
| C38 | C10 | C15 | C14 | 107.2° | 48.4° |
| C38 | C10 | C15 | H9 | 132.8° | 71.5° |
| C38 | C10 | C15 | H10 | 12.9° | 168.3° |
| C10 | C38 | H27 | H28 | 122.1° | 122.2° |
| C10 | C38 | C39 | H29 | 117.9° | 118.8° |
| C10 | C38 | C39 | H30 | 120.7° | 118.8° |
| C34 | C35 | C37 | H22 | 120.4° | 120.0° |
| C34 | C35 | C37 | H23 | 120.4° | 120.1° |
| C35 | C34 | O36 | N11 | 179.3° | 180.0° |
| C35 | C34 | N11 | C12 | 1.8° | 180.0° |
| C35 | C34 | N11 | C10 | 172.3° | 0.0° |
| C34 | C35 | H22 | H23 | 118.8° | 120.0° |
| C34 | C35 | C37 | H24 | 180.0° | 60.0° |
| C34 | C35 | C37 | H25 | 60.0° | 59.9° |
| C34 | C35 | C37 | H26 | 60.0° | 180.0° |
| C37 | C35 | C34 | O36 | 31.9° | 0.0° |
| C37 | C35 | C34 | N11 | 148.8° | 180.0° |
| C37 | C35 | H22 | H23 | 118.8° | 119.9° |
| C35 | C37 | H24 | H25 | 120.0° | 119.9° |
| C35 | C37 | H24 | H26 | 120.0° | 120.1° |
| C35 | C37 | H25 | H26 | 120.0° | 120.1° |
| O36 | C34 | N11 | C12 | 178.9° | 0.0° |
| O36 | C34 | N11 | C10 | 7.0° | 180.0° |
| O36 | C34 | C35 | H22 | 152.3° | 120.0° |
| O36 | C34 | C35 | H23 | 88.5° | 120.0° |
| C34 | N11 | C12 | C10 | 175.1° | 180.0° |
| C34 | N11 | C12 | C13 | 108.0° | 107.4° |
| C34 | N11 | C10 | C15 | 113.9° | 107.4° |
| C34 | N11 | C12 | H5 | 13.2° | 16.1° |
| C34 | N11 | C10 | H11 | 11.6° | 16.2° |
| N11 | C34 | C35 | H22 | 28.4° | 60.0° |
| N11 | C34 | C35 | H23 | 90.8° | 60.0° |
| N11 | C12 | C13 | H5 | 122.2° | 123.6° |
| C12 | N11 | C10 | C15 | 71.1° | 72.6° |
| N11 | C12 | C13 | C14 | 17.7° | 64.0° |
| N11 | C12 | C13 | H3 | 138.3° | 55.8° |
| N11 | C12 | C13 | H4 | 102.8° | 176.1° |
| C12 | N11 | C10 | H11 | 163.5° | 163.8° |
| N11 | C12 | C39 | H29 | 142.6° | 93.8° |
| N11 | C12 | C39 | H30 | 96.0° | 144.0° |
| C13 | C12 | N11 | C10 | 76.8° | 72.6° |
| C12 | C13 | C14 | H3 | 120.6° | 119.9° |
| C12 | C13 | C14 | H4 | 120.5° | 119.9° |
| C12 | C13 | C14 | C15 | 44.2° | 53.9° |
| C12 | C13 | C14 | N5 | 168.8° | 66.2° |
| C12 | C13 | C14 | H2 | 73.8° | 173.9° |
| C12 | C13 | H3 | H4 | 118.4° | 120.4° |
| C13 | C12 | C39 | H29 | 32.0° | 152.5° |
| C13 | C12 | C39 | H30 | 153.4° | 30.3° |
| N11 | C10 | C15 | H11 | 126.1° | 123.6° |
| N11 | C10 | C15 | C14 | 3.2° | 64.0° |
| C10 | N11 | C12 | H5 | 161.9° | 163.9° |
| N11 | C10 | C15 | H9 | 116.9° | 176.1° |
| N11 | C10 | C15 | H10 | 123.2° | 55.9° |
| N11 | C10 | C38 | H27 | 94.1° | 144.3° |
| N11 | C10 | C38 | H28 | 144.5° | 93.5° |
| C10 | C15 | C14 | C13 | 50.7° | 53.9° |
| C10 | C15 | C14 | H9 | 120.0° | 119.8° |
| C10 | C15 | C14 | H10 | 120.0° | 119.9° |
| C10 | C15 | C14 | N5 | 171.2° | 66.2° |
| C10 | C15 | C14 | H2 | 66.9° | 173.9° |
| C10 | C15 | H9 | H10 | 119.9° | 120.3° |
| C15 | C10 | C38 | H27 | 152.0° | 30.2° |
| C15 | C10 | C38 | H28 | 30.5° | 152.4° |
| C13 | C14 | C15 | N5 | 120.5° | 120.1° |
| C13 | C14 | C15 | H2 | 117.6° | 120.0° |
| C13 | C14 | N5 | H2 | 116.5° | 119.9° |
| C13 | C14 | N5 | N6 | 58.0° | 147.4° |
| C13 | C14 | N5 | C4 | 119.2° | 32.6° |
| C14 | C13 | H3 | H4 | 118.4° | 120.2° |
| C14 | C13 | C12 | H5 | 139.9° | 172.4° |
| C13 | C14 | C15 | H9 | 170.7° | 173.7° |
| C13 | C14 | C15 | H10 | 69.3° | 66.0° |
| C15 | C14 | N5 | H2 | 121.5° | 119.9° |
| C15 | C14 | N5 | N6 | 64.1° | 27.2° |
| C15 | C14 | N5 | C4 | 118.8° | 152.8° |
| C15 | C14 | C13 | H3 | 76.4° | 65.9° |
| C15 | C14 | C13 | H4 | 164.7° | 173.8° |
| C14 | C15 | H9 | H10 | 119.9° | 120.3° |
| C14 | C15 | C10 | H11 | 129.3° | 172.3° |
| C14 | N5 | N6 | C4 | 177.6° | 180.0° |
| C14 | N5 | N6 | C7 | 178.3° | 180.0° |
| C14 | N5 | C4 | N3 | 2.6° | 0.0° |
| C14 | N5 | C4 | C8 | 177.8° | NaN° |
| N5 | C14 | C13 | H3 | 48.2° | 174.0° |
| N5 | C14 | C13 | H4 | 70.7° | 53.8° |
| N5 | C14 | C15 | H9 | 68.8° | 53.6° |
| N5 | C14 | C15 | H10 | 51.1° | 173.9° |
| N5 | N6 | C7 | C17 | 178.3° | 180.0° |
| N5 | N6 | C7 | C8 | 0.6° | 0.1° |
| N6 | N5 | C4 | N3 | 180.0° | 180.0° |
| N6 | N5 | C4 | C8 | 0.5° | 0.0° |
| N6 | N5 | C14 | H2 | 174.5° | 92.7° |
| C7 | N6 | N5 | C4 | 0.7° | 0.1° |
| N6 | C7 | C17 | C18 | 36.7° | 135.7° |
| N6 | C7 | C17 | C8 | 178.6° | 179.9° |
| N6 | C7 | C8 | C4 | 0.4° | 0.0° |
| N6 | C7 | C17 | C22 | 133.9° | 44.4° |
| N6 | C7 | C8 | C9 | 179.3° | 180.0° |
| N5 | C4 | C8 | C7 | 0.1° | 0.0° |
| N5 | C4 | N3 | C8 | 179.5° | 180.0° |
| N5 | C4 | N3 | C2 | 179.8° | 180.0° |
| N5 | C4 | C8 | C9 | 179.8° | 180.0° |
| C4 | N5 | C14 | H2 | 2.7° | 87.3° |
| C19 | C18 | C17 | H1 | 180.0° | 179.7° |
| C18 | C19 | C20 | H13 | 180.0° | 180.0° |
| C19 | C18 | C17 | C7 | 175.5° | 179.9° |
| C19 | C18 | C17 | C22 | 5.0° | 0.0° |
| C18 | C19 | C20 | O23 | 179.0° | 180.0° |
| C18 | C19 | C20 | C21 | 2.3° | 0.1° |
| C17 | C18 | C19 | C20 | 1.0° | 0.0° |
| C18 | C17 | C7 | C22 | 170.6° | 179.9° |
| C18 | C17 | C7 | C8 | 144.7° | 44.2° |
| C18 | C17 | C22 | C21 | 6.0° | 0.0° |
| C18 | C17 | C22 | H12 | 174.0° | 180.0° |
| C17 | C18 | C19 | H13 | 179.0° | 180.0° |
| C19 | C20 | O23 | C21 | 178.8° | 180.0° |
| C19 | C20 | O23 | C24 | 85.1° | 3.3° |
| C19 | C20 | C21 | C22 | 1.4° | 0.0° |
| C19 | C20 | C21 | C40 | 178.7° | 180.0° |
| C20 | C19 | C18 | H1 | 179.1° | 179.7° |
| C17 | C7 | C8 | C4 | 178.2° | 180.0° |
| C17 | C7 | C8 | C9 | 2.1° | 0.1° |
| C7 | C17 | C22 | C21 | 176.4° | 179.9° |
| C7 | C17 | C18 | H1 | 4.5° | 0.4° |
| C7 | C17 | C22 | H12 | 3.6° | 0.1° |
| C7 | C8 | C4 | N3 | 179.7° | 180.0° |
| C7 | C8 | C4 | C9 | 179.7° | 180.0° |
| C8 | C7 | C17 | C22 | 44.7° | 135.7° |
| C7 | C8 | C9 | N1 | 179.9° | 180.0° |
| C7 | C8 | C9 | C16 | 1.3° | 0.0° |
| N3 | C4 | C8 | C9 | 0.6° | 0.0° |
| C4 | N3 | C2 | N1 | 0.3° | 0.0° |
| C4 | N3 | C2 | H14 | 179.7° | 180.0° |
| C8 | C4 | N3 | C2 | 0.2° | 0.0° |
| C4 | C8 | C9 | N1 | 0.5° | 0.0° |
| C4 | C8 | C9 | C16 | 178.3° | 180.0° |
| C17 | C22 | C21 | C20 | 2.7° | 0.0° |
| C17 | C22 | C21 | H12 | 180.0° | 180.0° |
| C17 | C22 | C21 | C40 | 177.2° | 180.0° |
| C22 | C17 | C18 | H1 | 175.0° | 179.7° |
| C20 | O23 | C24 | C25 | 169.0° | 80.1° |
| C20 | O23 | C24 | C29 | 11.7° | 100.1° |
| O23 | C20 | C21 | C22 | 179.9° | 180.0° |
| O23 | C20 | C21 | C40 | 0.0° | 0.0° |
| O23 | C20 | C19 | H13 | 1.0° | 0.0° |
| C21 | C20 | O23 | C24 | 96.1° | 176.8° |
| C20 | C21 | C22 | C40 | 179.9° | 180.0° |
| C20 | C21 | C22 | H12 | 177.3° | 180.0° |
| C21 | C20 | C19 | H13 | 177.7° | 180.0° |
| C20 | C21 | C40 | H31 | 90.0° | 90.0° |
| C20 | C21 | C40 | H32 | 150.0° | 30.0° |
| C20 | C21 | C40 | H33 | 30.0° | 150.0° |
| O23 | C24 | C25 | C29 | 179.3° | 179.7° |
| O23 | C24 | C25 | C26 | 179.4° | 179.7° |
| O23 | C24 | C29 | C28 | 179.1° | 179.7° |
| O23 | C24 | C25 | H15 | 0.6° | 0.3° |
| O23 | C24 | C29 | H17 | 0.9° | 0.2° |
| N3 | C2 | N1 | H14 | 180.0° | 180.0° |
| N3 | C2 | N1 | C9 | 0.4° | 0.0° |
| C8 | C9 | N1 | C2 | 0.0° | 0.0° |
| C8 | C9 | N1 | C16 | 178.9° | 180.0° |
| C8 | C9 | C16 | H6 | 178.9° | 86.1° |
| C8 | C9 | C16 | H7 | 61.1° | 153.8° |
| C8 | C9 | C16 | H8 | 58.9° | 33.8° |
| C24 | C25 | C26 | H15 | 180.0° | 180.0° |
| C24 | C25 | C26 | C27 | 0.2° | 0.0° |
| C25 | C24 | C29 | C28 | 0.2° | 0.0° |
| C24 | C25 | C26 | H16 | 179.8° | 179.9° |
| C25 | C24 | C29 | H17 | 179.8° | 180.0° |
| C26 | C25 | C24 | C29 | 0.1° | 0.0° |
| C25 | C26 | C27 | H16 | 180.0° | 180.0° |
| C25 | C26 | C27 | C28 | 0.0° | 0.0° |
| C25 | C26 | C27 | N30 | 179.5° | 180.0° |
| C24 | C29 | C28 | H17 | 180.0° | 179.9° |
| C24 | C29 | C28 | C27 | 0.4° | 0.1° |
| C24 | C29 | C28 | N32 | 179.9° | 180.0° |
| C29 | C24 | C25 | H15 | 179.9° | 180.0° |
| C22 | C21 | C40 | H31 | 90.0° | 90.0° |
| C22 | C21 | C40 | H32 | 30.0° | 150.0° |
| C22 | C21 | C40 | H33 | 150.0° | 30.0° |
| C40 | C21 | C22 | H12 | 2.8° | 0.0° |
| C21 | C40 | H31 | H32 | 120.0° | 119.9° |
| C21 | C40 | H31 | H33 | 120.0° | 120.0° |
| C21 | C40 | H32 | H33 | 120.0° | 120.0° |
| C26 | C27 | C28 | C29 | 0.3° | 0.1° |
| C26 | C27 | C28 | N30 | 179.6° | 180.0° |
| C26 | C27 | C28 | N32 | 179.9° | 180.0° |
| C26 | C27 | N30 | C33 | 1.0° | 0.1° |
| C26 | C27 | N30 | C31 | 179.3° | 180.0° |
| C27 | C26 | C25 | H15 | 179.8° | 180.0° |
| C2 | N1 | C9 | C16 | 178.9° | 180.0° |
| C29 | C28 | C27 | N32 | 179.8° | 180.0° |
| C29 | C28 | C27 | N30 | 179.9° | 180.0° |
| C29 | C28 | N32 | C31 | 179.5° | 180.0° |
| N1 | C9 | C16 | H6 | 0.0° | 93.9° |
| N1 | C9 | C16 | H7 | 120.0° | 26.2° |
| N1 | C9 | C16 | H8 | 120.0° | 146.2° |
| C9 | N1 | C2 | H14 | 179.6° | 180.0° |
| C9 | C16 | H6 | H7 | 120.0° | 120.0° |
| C9 | C16 | H6 | H8 | 120.0° | 120.0° |
| C9 | C16 | H7 | H8 | 120.0° | 120.0° |
| C28 | C27 | N30 | C33 | 178.6° | 180.0° |
| C28 | C27 | N30 | C31 | 0.3° | 0.0° |
| C27 | C28 | N32 | C31 | 0.8° | 0.0° |
| C28 | C27 | C26 | H16 | 180.0° | 180.0° |
| C27 | C28 | C29 | H17 | 179.6° | 180.0° |
| N30 | C27 | C28 | N32 | 0.3° | 0.0° |
| C27 | N30 | C33 | C31 | 177.8° | 180.0° |
| C27 | N30 | C31 | N32 | 1.0° | 0.0° |
| N30 | C27 | C26 | H16 | 0.5° | 0.1° |
| C27 | N30 | C31 | H18 | 179.0° | 180.0° |
| C27 | N30 | C33 | H19 | 180.0° | 90.0° |
| C27 | N30 | C33 | H20 | 60.0° | 150.0° |
| C27 | N30 | C33 | H21 | 60.0° | 30.0° |
| C28 | N32 | C31 | N30 | 1.1° | 0.0° |
| N32 | C28 | C29 | H17 | 0.1° | 0.0° |
| C28 | N32 | C31 | H18 | 178.9° | 180.0° |
| C33 | N30 | C31 | N32 | 179.3° | 180.0° |
| C33 | N30 | C31 | H18 | 0.7° | 0.0° |
| N30 | C33 | H19 | H20 | 120.0° | 120.0° |
| N30 | C33 | H19 | H21 | 120.0° | 120.0° |
| N30 | C33 | H20 | H21 | 120.0° | 120.0° |
| N30 | C31 | N32 | H18 | 180.0° | 179.9° |
| C31 | N30 | C33 | H19 | 2.2° | 90.0° |
| C31 | N30 | C33 | H20 | 117.8° | 30.0° |
| C31 | N30 | C33 | H21 | 122.1° | 150.0° |
| H1 | C18 | C19 | H13 | 0.9° | 0.3° |
| H2 | C14 | C13 | H3 | 165.6° | 54.0° |
| H2 | C14 | C13 | H4 | 46.7° | 66.2° |
| H2 | C14 | C15 | H9 | 53.1° | 66.3° |
| H2 | C14 | C15 | H10 | 173.0° | 53.9° |
| H3 | C13 | C12 | H5 | 99.6° | 67.7° |
| H4 | C13 | C12 | H5 | 19.3° | 52.6° |
| H5 | C12 | C39 | H29 | 95.1° | 28.1° |
| H5 | C12 | C39 | H30 | 26.4° | 94.1° |
| H6 | C16 | H7 | H8 | 120.0° | 120.0° |
| H9 | C15 | C10 | H11 | 9.2° | 52.5° |
| H10 | C15 | C10 | H11 | 110.7° | 67.8° |
| H11 | C10 | C38 | H27 | 28.5° | 93.7° |
| H11 | C10 | C38 | H28 | 93.0° | 28.5° |
| H15 | C25 | C26 | H16 | 0.2° | 0.0° |
| H19 | C33 | H20 | H21 | 119.9° | 120.0° |
| H22 | C35 | C37 | H24 | 59.6° | 179.9° |
| H22 | C35 | C37 | H25 | 179.6° | 60.1° |
| H22 | C35 | C37 | H26 | 60.4° | 60.0° |
| H23 | C35 | C37 | H24 | 59.6° | 60.1° |
| H23 | C35 | C37 | H25 | 60.4° | 180.0° |
| H23 | C35 | C37 | H26 | 179.6° | 59.9° |
| H24 | C37 | H25 | H26 | 120.0° | 120.0° |
| H27 | C38 | C39 | H29 | 122.8° | 122.5° |
| H27 | C38 | C39 | H30 | 1.4° | 0.1° |
| H28 | C38 | C39 | H29 | 1.4° | 0.3° |
| H28 | C38 | C39 | H30 | 120.0° | 122.7° |
| H31 | C40 | H32 | H33 | 120.0° | 120.1° |
